2-[5-(furan-2-yl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine

Systemtic Name: 2-[5-(furan-2-yl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine Openeye Name: 2-[5-(2-furyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine CAS Name: 2-[5-(2-furanyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine IUPAC Name: 2-[5-(furan-2-yl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine Traditional Name: 2-[5-(2-furyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-mesyl-pyridine Formula: C13H9F3N4O3S MolecularWeight: 358.29577

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C13H9F3N4O3S/c1-24(21,22)8-4-5-10(17-7-8)20-11(9-3-2-6-23-9)18-12(19-20)13(14,15)16/h2-7H,1H3